orbital_charges     :real:2:4,12
  0.126000751299380E+001  0.960115715118964E+000  0.991186397285794E+000
  0.966358190190963E+000  0.126669166048249E+001  0.959673850857575E+000
  0.104058338911720E+001  0.969628570496511E+000  0.123940780949372E+001
  0.984632563085248E+000  0.101486329638131E+001  0.988218058303370E+000
  0.127270603354239E+001  0.100873054817906E+001  0.999346029004514E+000
  0.979860549585079E+000  0.891433947658950E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.922463975179182E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.906475921480179E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.868731936913069E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.889096172484770E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.866755456109908E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.878074328349814E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.874958087706152E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,12
 -0.895658505914636E-001 -0.720221903849640E-001 -0.889429110422192E-001
  0.686110823532206E-001  0.971208952111701E-001  0.104453654733219E+000
  0.177459115355832E+000  0.574169757281775E-001 -0.160924641750218E+000
 -0.100163363388503E+000 -0.600490162269703E-001 -0.407539717328254E-001
 -0.752706981525776E-002  0.805706161476434E-001  0.931206144296288E-001
  0.662323663263923E-002 -0.753528387588112E-002  0.226265890872090E-001
  0.281633498573264E-002 -0.404052840716232E-001  0.537656255805090E-001
  0.662926160531887E-002 -0.659091527019303E-001 -0.100384885110669E+000
 -0.584600251719549E-001  0.135781903024145E-001 -0.565885207957134E-001
 -0.101531597112588E+000  0.983284405927592E-002  0.169265231376435E+000
  0.554885482721952E-001 -0.499490944452999E-002 -0.572986292878734E-001
  0.396203268748290E-001 -0.760368474278250E-002  0.616618445125175E-001
mermin_energy       :real:0:
 -0.969175116569778E+001
end_coords          :real:2:3,12
  0.188974488583881E+000  0.205809868443532E+001 -0.194641776823629E-003
 -0.377947087441773E+000 -0.224707128329321E+001 -0.189161571456750E+000
 -0.224707128329321E+001 -0.188974488583881E+000  0.189167240634716E+000
  0.224707128329321E+001  0.188974488583881E+000  0.189167240634716E+000
  0.000000000000000E+000  0.308718109685778E+001  0.150063518698250E+001
  0.000000000000000E+000  0.308623245441151E+001 -0.187964052097788E+001
  0.000000000000000E+000 -0.308718109685778E+001  0.150063518698250E+001
  0.000000000000000E+000 -0.346417765212729E+001 -0.150169532326209E+001
 -0.308718109685778E+001  0.000000000000000E+000 -0.150063518698250E+001
 -0.308623245441151E+001  0.000000000000000E+000  0.169066792211999E+001
  0.308718109685778E+001  0.000000000000000E+000 -0.150063518698250E+001
  0.308623245441151E+001  0.000000000000000E+000  0.187964070995048E+001
